dimethyl-[2-(octadecanoylamino)hexadecanoyloxy]-propyl-azanium chloride

Systemtic Name: dimethyl-[2-(octadecanoylamino)hexadecanoyloxy]-propyl-azanium chloride Openeye Name: dimethyl-[2-(octadecanoylamino)hexadecanoyloxy]-propyl-ammonium chloride CAS Name: dimethyl-[1-oxo-2-(1-oxooctadecylamino)hexadecoxy]-propylammonium chloride IUPAC Name: dimethyl-[2-(octadecanoylamino)hexadecanoyloxy]-propylazanium chloride Traditional Name: dimethyl-propyl-(2-stearamidohexadecanoyloxy)ammonium chloride Formula: C39H79ClN2O3 MolecularWeight: 659.50916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NC(CCCCCCCCCCCCCC)C(=O)O[N+](C)(C)CCC.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NC(CCCCCCCCCCCCCC)C(=O)O[N+](C)(C)CCC.[Cl-]

InChI

InChI=1S/C39H78N2O3.ClH/c1-6-9-11-13-15-17-19-21-22-23-25-27-29-31-33-35-38(42)40-37(39(43)44-41(4,5)36-8-3)34-32-30-28-26-24-20-18-16-14-12-10-7-2;/h37H,6-36H2,1-5H3;1H